CID 80143168

2-(6,6-dimethylmorpholin-2-yl)acetic acid hydrochloride

Structural Information

Molecular Formula
C8H15NO3
SMILES
CC1(CNCC(O1)CC(=O)O)C
InChI
InChI=1S/C8H15NO3/c1-8(2)5-9-4-6(12-8)3-7(10)11/h6,9H,3-5H2,1-2H3,(H,10,11)
InChIKey
ONGVAFMXVCXFMU-UHFFFAOYSA-N
Compound name
2-(6,6-dimethylmorpholin-2-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.1052 Da
Monoisotopic Mass

-2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.11248 138.5
[M+Na]+ 196.09442 147.8
[M+NH4]+ 191.13902 146.4
[M+K]+ 212.06836 142.5
[M-H]- 172.09792 138.9
[M+Na-2H]- 194.07987 142.2
[M]+ 173.10465 139.7
[M]- 173.10575 139.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.